Vitas-M small molecule compound
(8S,8aR,11aS)-10-(3,5-dichlorophenyl)-8-[(3-nitrophenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Catalog ID
STK547970
SMILES Clc1cc(Cl)cc(c1)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2cccc(c2)[N+](=O)[O-])C=Cc2c1cccc2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C27H17Cl2N3O5 MW 534.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H17Cl2N3O5/c28-16-11-17(29)13-19(12-16)31-26(34)21-22(27(31)35)24(25(33)15-5-3-6-18(10-15)32(36)37)30-9-8-14-4-1-2-7-20(14)23(21)30/h1-13,21-24H/t21-,22+,23?,24-/m0/s1InChIKey
PQCZGDMCCXFVTA-UZLDWMDBSA-NSynonyms
956813-92-6(8S8aR11aS)10(35dichlorophenyl)8((3nitrophenyl)carbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
(8S8aR11aS)10(35dichlorophenyl)8(3nitrobenzoyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
956813926
C1=CC=C2C3C4C(C(N3C=CC2=C1)C(=O)C5=CC(=CC=C5)(N+)(=O)(O))C(=O)N(C4=O)C6=CC(=CC(=C6)Cl)Cl
Clc1cc(Cl)cc(c1)N1C(=O)(C@@H)2(C@H)(C1=O)C1N((C@@H)2C(=O)c2cccc(c2)(N+)(=O)(O))C=Cc2c1cccc2
InChI=1SC27H17Cl2N3O5c28161117(29)1319(1216)3126(34)2122(27(31)35)24(25(33)1553618(1015)32(36)37)309814412720(14)23(21)30h1132124Ht2122+23?24m0s1
MFCD18242387
ZINC000100845025
ZINC000100845027
Check stock
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Check stock on Vitas-MAvailable files
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